1-(3-methoxyphenyl)-3-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]thiourea

Systemtic Name: 1-(3-methoxyphenyl)-3-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]thiourea Openeye Name: 1-(3-methoxyphenyl)-3-[1-(m-tolylmethyl)-1,2,4-triazol-3-yl]thiourea CAS Name: 1-(3-methoxyphenyl)-3-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]thiourea IUPAC Name: 1-(3-methoxyphenyl)-3-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]thiourea Traditional Name: 1-(3-methoxyphenyl)-3-[1-(3-methylbenzyl)-1,2,4-triazol-3-yl]thiourea Formula: C18H19N5OS MolecularWeight: 353.44136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=NC(=N2)NC(=S)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=NC(=N2)NC(=S)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C18H19N5OS/c1-13-5-3-6-14(9-13)11-23-12-19-17(22-23)21-18(25)20-15-7-4-8-16(10-15)24-2/h3-10,12H,11H2,1-2H3,(H2,20,21,22,25)